%chk=000278109.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278109

0 1
S 1.897746 -1.329930 0.990044
S -4.917702 0.240836 0.101180
O 0.454525 -0.917283 0.232722
O 2.248456 -2.650048 0.526056
O 1.700801 -1.082565 2.401533
C -1.919475 -0.749386 -0.080479
C -0.800088 -1.080479 0.938727
C -1.652752 -1.230658 -1.520827
C -0.963538 -2.463996 1.582314
C -1.125285 -2.664908 -1.644863
C -0.782173 -3.672395 0.660870
C -1.662682 -3.645630 -0.594985
C -2.194369 0.741448 -0.116528
C -3.491626 1.267509 -0.063086
C -1.118314 1.642082 -0.229273
C -3.719880 2.647449 -0.091023
C -1.337257 3.018793 -0.258212
C 2.924966 -0.147639 0.289263
C -2.639724 3.527378 -0.182263
C 3.129303 1.075826 0.939566
C 3.562722 -0.404237 -0.930462
C -5.125040 -0.413032 -1.574587
C 3.959770 2.041081 0.372635
C 4.394186 0.557636 -1.503013
C 4.597041 1.789615 -0.856069
C 5.496751 2.814810 -1.458678
H -2.832323 -1.292276 0.293314
H -0.784513 -0.308542 1.751050
H -0.922651 -0.549011 -2.003226
H -2.603559 -1.128918 -2.093144
H -1.971088 -2.506167 2.048001
H -0.257604 -2.554496 2.438801
H -0.015609 -2.639301 -1.575014
H -1.355298 -3.043226 -2.658828
H -0.994010 -4.592777 1.240269
H 0.288218 -3.754479 0.360581
H -2.708653 -3.403159 -0.331547
H -1.692929 -4.663622 -1.030936
H -0.101518 1.244870 -0.297160
H -4.737614 3.038689 -0.041902
H -0.492751 3.701161 -0.341421
H -2.809529 4.601501 -0.199008
H 2.641961 1.273795 1.901823
H 3.415158 -1.366282 -1.435191
H -4.190541 -0.859369 -1.955993
H -5.449859 0.366145 -2.271282
H -5.894222 -1.193830 -1.538521
H 4.117534 2.988846 0.884364
H 4.888433 0.351668 -2.450853
H 6.533903 2.671403 -1.114588
H 5.515558 2.767261 -2.556728
H 5.209946 3.840835 -1.188322


%chk=000278109-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278109

0 1
S 1.882997 -1.071120 1.437926
S -4.818277 0.221127 0.666366
O 0.486722 -1.165085 0.182197
O 2.603609 -2.519100 1.530994
O 1.302140 -0.343515 2.768945
C -1.896485 -0.853464 -0.265415
C -0.857143 -1.320148 0.807120
C -1.615707 -1.316446 -1.728926
C -1.096737 -2.745172 1.350992
C -1.081838 -2.759576 -1.925683
C -0.875945 -3.921078 0.373831
C -1.646258 -3.840905 -0.967744
C -2.111913 0.660218 -0.212381
C -3.351187 1.249236 0.171895
C -1.040377 1.535612 -0.543215
C -3.499273 2.656663 0.229409
C -1.185854 2.936838 -0.488055
C 2.990425 0.110919 0.497888
C -2.420671 3.505670 -0.099901
C 2.787165 1.489511 0.671825
C 3.992550 -0.431523 -0.321040
C -5.564951 -0.105845 -1.043929
C 3.645847 2.367930 -0.023622
C 4.835287 0.470861 -1.006255
C 4.676782 1.875663 -0.868943
C 5.612330 2.832543 -1.583696
H -2.841006 -1.327652 0.066251
H -0.910159 -0.617487 1.664701
H -0.898339 -0.618136 -2.198432
H -2.568245 -1.194659 -2.284369
H -2.138184 -2.763283 1.733501
H -0.441776 -2.891394 2.233401
H 0.018552 -2.748319 -1.808906
H -1.287537 -3.050058 -2.975313
H -1.158755 -4.851625 0.905664
H 0.205932 -4.004759 0.152215
H -2.728506 -3.674971 -0.783822
H -1.566537 -4.828101 -1.464605
H -0.080183 1.095643 -0.833939
H -4.462308 3.075669 0.539088
H -0.339736 3.583735 -0.748123
H -2.544301 4.593157 -0.051259
H 1.999983 1.859636 1.336840
H 4.115467 -1.515796 -0.405815
H -4.863633 -0.687996 -1.661264
H -5.803342 0.850519 -1.533202
H -6.486819 -0.684193 -0.873400
H 3.514687 3.449437 0.095370
H 5.626653 0.077146 -1.653968
H 6.496638 3.056731 -0.956271
H 5.983200 2.406593 -2.531883
H 5.117816 3.793345 -1.807942


